4784-0002 Screening compound: (5Z)-1-(2-fluorophenyl)-5-[(furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione

4784-0002 Screening compound: (5Z)-1-(2-fluorophenyl)-5-[(furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
4784-0002 Screening compound: (5Z)-1-(2-fluorophenyl)-5-[(furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4784-0002
(5Z)-1-(2-fluorophenyl)-5-[(furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

4784-0002

Molecular Formula

C15H9FN2O4 (C15 H9 FN2 O4)

Compound Name

(5Z)-1-(2-fluorophenyl)-5-[(furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione

IUPAC name

(5Z)-1-(2-fluorophenyl)-5-[(furan-2-yl)methylidene]-13-diazinane-246-trione

SMILES

O=C(/C(/C(N1c(cccc2)c2F)=O)=C/c2ccco2)NC1=O

InChI

InChI=1S/C15H9FN2O4/c16-11-5-1-2-6-12(11)18-14(20)10(13(19)17-15(18)21)8-9-4-3-7-22-9/h1-8H,(H,17,19,21)

InChI Key

XJUWAYOSEKJPQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14710210

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.25

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.576

Distribution Coefficient, logD

0.606

Water Solubility, LogSw

-1.79

Polar Surface Area

60.839

Acid Dissociation Constant (pKa)

6.48

Base Dissociation Constant (pKb)

-7.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

4784-0002 in Drug Discovery

Included in Screening Libraries

Human Transcription Factors Annotated Library (5098 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4784-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4784-0002?
Check Price and Availability of 4784-0002, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4784-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4784-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4784-0002
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 4784-0002 available by request